#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orl s SER 2 N 0.00 6.61 -0.19 -5.58 0.15 -1.26 -1.73 113.70 111.69 1orl s SER 2 Ca 0.00 0.76 -0.04 0.00 0.70 0.00 0.00 55.95 57.37 1orl s SER 2 Cb 0.00 -2.16 0.09 0.00 -1.71 0.00 0.00 66.02 62.24 1orl s SER 2 CO 0.00 0.16 0.25 0.00 1.20 0.00 0.00 173.24 174.84 1orl h PRO 5 N 1.77 1.06 0.00 0.00 0.13 -1.84 -1.57 132.00 131.55 1orl h PRO 5 Ca -0.47 -0.21 0.12 0.00 -0.87 0.00 0.00 66.00 64.57 1orl h PRO 5 Cb 1.24 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 1orl h PRO 5 CO 0.61 0.90 0.46 0.27 -0.23 0.00 0.00 178.00 180.01 1orl n ASN 6 N -4.26 -1.40 -0.21 1.44 0.23 -1.26 -4.37 115.26 105.42 1orl n ASN 6 Ca 0.06 -1.75 0.06 0.00 -0.53 0.00 0.00 54.58 52.42 1orl n ASN 6 Cb 0.22 2.28 0.33 0.00 -2.08 0.00 0.00 39.78 40.54 1orl n ASN 6 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1orl h THR 7 N 1.79 1.01 -0.24 5.53 2.02 -1.99 -1.07 112.91 119.95 1orl h THR 7 Ca -0.22 -0.27 -0.19 0.00 0.77 0.00 0.00 66.41 66.50 1orl h THR 7 Cb 0.96 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1orl h THR 7 CO 0.29 0.15 -0.59 0.74 0.37 0.00 0.00 175.52 176.48 1orl h THR 8 N 0.80 1.29 -0.27 3.16 2.02 -1.98 -0.17 112.91 117.75 1orl h THR 8 Ca 0.34 -1.79 0.05 0.00 0.77 0.00 0.00 66.41 65.78 1orl h THR 8 Cb 0.29 1.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.37 1orl h THR 8 CO -0.12 0.58 -0.06 1.23 0.37 0.00 0.00 175.52 177.51 1orl h GLY 9 N 0.76 0.20 0.66 2.16 0.00 -1.67 -0.62 103.07 104.55 1orl h GLY 9 Ca 0.00 0.09 0.05 0.00 0.00 0.00 0.00 47.33 47.46 1orl h GLY 9 CO 0.13 -0.10 0.12 3.21 0.00 0.00 0.00 176.54 179.90 1orl h ARG 10 N 0.01 0.26 -0.25 4.80 2.47 -1.08 -1.22 114.38 119.36 1orl h ARG 10 Ca 0.13 -0.02 0.05 0.00 -1.26 0.00 0.00 59.98 58.88 1orl h ARG 10 Cb 0.20 -0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 28.41 1orl h ARG 10 CO -0.27 0.17 -0.04 -0.97 0.56 0.00 0.00 179.97 179.42 1orl h ASN 11 N 0.27 -0.19 -0.15 7.04 -1.24 -0.38 0.50 115.58 121.44 1orl h ASN 11 Ca 0.17 0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.25 1orl h ASN 11 Cb 0.16 0.14 -0.01 0.00 0.73 0.00 0.00 38.32 39.34 1orl h ASN 11 CO -0.18 -0.06 0.07 0.40 -1.29 0.00 0.00 177.43 176.37 1orl h ILE 12 N 0.03 1.12 0.07 2.57 2.04 -0.95 -0.50 117.51 121.87 1orl h ILE 12 Ca 0.12 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.67 1orl h ILE 12 Cb 0.18 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1orl h ILE 12 CO -0.24 0.11 -0.22 0.22 0.00 0.00 0.00 178.15 178.01 1orl h TYR 13 N 0.12 -0.59 -0.25 1.37 3.20 -0.89 -0.77 116.97 119.15 1orl h TYR 13 Ca 0.05 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1orl h TYR 13 Cb 0.11 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1orl h TYR 13 CO -0.03 -0.32 0.12 -0.91 -1.64 0.00 0.00 178.16 175.39 1orl h ASN 14 N -0.39 0.32 -0.39 -2.11 2.35 -0.85 -0.52 115.58 113.98 1orl h ASN 14 Ca 0.04 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1orl h ASN 14 Cb 0.44 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.69 1orl h ASN 14 CO -0.16 0.34 0.16 0.74 -1.65 0.00 0.00 177.43 176.86 1orl h THR 15 N 0.27 0.92 -0.65 2.81 2.02 -0.92 -0.12 112.91 117.23 1orl h THR 15 Ca 0.09 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1orl h THR 15 Cb 0.10 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 1orl h THR 15 CO -0.01 0.06 0.30 0.00 0.37 0.00 0.00 175.52 176.24 1orl h ARG 17 N 0.91 0.54 -0.67 0.00 2.47 -0.55 -0.87 114.38 116.21 1orl h ARG 17 Ca 0.22 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.87 1orl h ARG 17 Cb 0.14 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 1orl h ARG 17 CO -0.03 0.37 0.25 0.74 0.56 0.00 0.00 179.97 181.86 1orl h PHE 18 N 0.56 1.03 -0.63 3.04 0.04 -0.81 -2.91 116.94 117.26 1orl h PHE 18 Ca 0.15 -0.08 0.04 0.00 2.80 0.00 0.00 57.97 60.88 1orl h PHE 18 Cb -0.06 -0.31 -0.05 0.00 2.20 0.00 0.00 35.95 37.74 1orl h PHE 18 CO -0.05 0.81 0.37 0.00 -0.60 0.00 0.00 178.31 178.84 1orl h ALA 19 N 1.11 0.83 0.00 2.45 0.00 -0.62 -3.47 119.26 119.57 1orl h ALA 19 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1orl h ALA 19 Cb 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1orl h ALA 19 CO -0.02 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1orl n GLY 20 N -1.28 0.62 3.69 0.00 0.00 -0.41 -5.09 105.19 102.72 1orl n GLY 20 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1orl n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1orl n GLY 21 N 0.00 0.31 3.71 -0.02 0.00 -0.73 -4.92 105.19 103.54 1orl n GLY 21 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1orl n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1orl s SER 22 N -1.17 3.58 0.10 1.61 0.01 -1.26 -4.30 113.70 112.27 1orl s SER 22 Ca 0.77 2.07 -0.31 0.00 1.31 0.00 0.00 55.95 59.78 1orl s SER 22 Cb -0.41 -2.55 -0.12 0.00 0.21 0.00 0.00 66.02 63.15 1orl s SER 22 CO 0.46 -2.66 1.60 0.03 0.41 0.00 0.00 173.24 173.08 1orl h ARG 23 N -1.49 -0.68 -0.44 12.44 3.08 -1.99 -0.26 114.38 125.05 1orl h ARG 23 Ca -0.44 0.05 0.02 0.00 0.07 0.00 0.00 59.98 59.69 1orl h ARG 23 Cb 1.26 0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.43 1orl h ARG 23 CO 0.46 -0.45 0.25 1.49 -1.07 0.00 0.00 179.97 180.64 1orl h GLU 24 N -0.70 0.49 0.34 0.04 4.22 -1.97 0.31 114.58 117.30 1orl h GLU 24 Ca -0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 1orl h GLU 24 Cb 0.68 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1orl h GLU 24 CO -0.16 0.32 -0.22 -0.09 -2.18 0.00 0.00 179.01 176.69 1orl h ARG 25 N 0.50 -0.52 -0.84 1.92 1.12 -1.87 0.15 114.38 114.84 1orl h ARG 25 Ca 0.18 0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 59.08 1orl h ARG 25 Cb 0.04 0.12 -0.04 0.00 -0.01 0.00 0.00 29.97 30.07 1orl h ARG 25 CO -0.10 -0.35 0.49 0.00 -3.11 0.00 0.00 179.97 176.91 1orl h ALA 27 N 1.27 1.06 0.16 0.00 0.00 -0.66 -1.30 119.26 119.79 1orl h ALA 27 Ca 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1orl h ALA 27 Cb -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1orl h ALA 27 CO -0.05 0.43 -0.08 -0.22 0.00 0.00 0.00 179.25 179.33 1orl h LYS 28 N 1.10 -0.21 -0.59 0.00 3.11 -0.40 0.32 116.57 119.90 1orl h LYS 28 Ca 0.31 0.01 0.10 0.00 -2.81 0.00 0.00 60.65 58.26 1orl h LYS 28 Cb -0.10 0.05 -0.08 0.00 -1.00 0.00 0.00 32.23 31.10 1orl h LYS 28 CO -0.08 -0.10 0.18 1.25 -2.81 0.00 0.00 179.45 177.90 1orl h LEU 29 N -0.26 0.14 -0.05 5.20 5.85 -0.85 -2.51 115.31 122.84 1orl h LEU 29 Ca -0.02 0.09 -0.25 0.00 0.84 0.00 0.00 57.88 58.54 1orl h LEU 29 Cb 0.20 0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.33 1orl h LEU 29 CO 0.04 0.08 -1.07 0.77 -0.34 0.00 0.00 178.44 177.92 1orl h SER 30 N 0.34 0.58 0.00 1.25 4.64 -1.19 -3.48 113.55 115.69 1orl h SER 30 Ca 0.30 -0.51 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1orl h SER 30 Cb 0.40 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1orl h SER 30 CO -0.34 1.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 1orl n GLY 31 N 1.16 1.05 3.90 -0.77 0.00 0.42 -4.78 105.19 106.18 1orl n GLY 31 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1orl n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orl s LYS 33 N -4.96 2.93 -0.32 0.00 -0.14 -0.01 -4.13 119.74 113.11 1orl s LYS 33 Ca 0.52 -0.68 0.03 0.00 -1.36 0.00 0.00 55.97 54.48 1orl s LYS 33 Cb -0.11 -2.75 0.09 0.00 -1.68 0.00 0.00 37.83 33.39 1orl s LYS 33 CO 0.47 0.57 0.04 0.42 -0.76 0.00 0.00 175.35 176.09 1orl s ILE 34 N -1.42 2.03 -0.02 2.17 -1.09 -1.26 -1.47 121.20 120.15 1orl s ILE 34 Ca 0.30 -2.09 0.00 0.00 -2.23 0.00 0.00 60.65 56.63 1orl s ILE 34 Cb -0.12 -2.46 0.02 0.00 -1.58 0.00 0.00 42.46 38.32 1orl s ILE 34 CO 0.23 -0.53 0.00 0.27 -1.23 0.00 0.00 174.94 173.68 1orl s ILE 35 N 1.05 0.10 -0.63 2.92 -4.36 -0.71 -4.97 121.20 114.60 1orl s ILE 35 Ca 0.08 0.06 -0.01 0.00 -0.26 0.00 0.00 60.65 60.52 1orl s ILE 35 Cb -0.19 -0.17 0.49 0.00 1.25 0.00 0.00 42.46 43.85 1orl s ILE 35 CO -0.10 0.09 2.02 -0.24 0.24 0.00 0.00 174.94 176.95 1orl n SER 36 N 3.73 6.97 -0.21 4.36 2.88 -1.26 -0.84 113.62 129.24 1orl n SER 36 Ca -0.22 -3.76 0.14 0.00 -1.33 0.00 0.00 58.87 53.71 1orl n SER 36 Cb 0.54 -0.95 0.65 0.00 -0.75 0.00 0.00 64.21 63.69 1orl n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1orl n ALA 37 N -0.96 2.71 -2.05 -1.46 0.00 -1.26 -4.85 120.51 112.64 1orl n ALA 37 Ca 0.62 -0.32 -0.17 0.00 0.00 0.00 0.00 53.44 53.58 1orl n ALA 37 Cb 0.85 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.96 1orl n ALA 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1orl n SER 38 N -0.59 -4.84 -3.62 0.00 2.88 -1.26 -4.94 113.62 101.25 1orl n SER 38 Ca 0.18 0.22 -0.16 0.00 -1.33 0.00 0.00 58.87 57.78 1orl n SER 38 Cb 0.27 -4.18 -0.07 0.00 -0.75 0.00 0.00 64.21 59.48 1orl n SER 38 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1orl s THR 39 N -2.70 0.02 0.02 2.46 2.01 -1.26 -5.12 115.64 111.07 1orl s THR 39 Ca 0.00 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.88 1orl s THR 39 Cb 0.00 -0.86 -0.01 0.00 0.01 0.00 0.00 72.50 71.63 1orl s THR 39 CO 0.00 -0.07 -0.03 0.00 -0.69 0.00 0.00 174.62 173.83 1orl s PRO 41 N -1.04 1.94 -1.12 0.00 0.04 -1.26 -4.89 135.00 128.67 1orl s PRO 41 Ca -0.10 0.85 -0.14 0.00 0.04 0.00 0.00 61.00 61.65 1orl s PRO 41 Cb -0.07 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.51 1orl s PRO 41 CO -0.00 -1.78 2.22 0.43 0.04 0.00 0.00 177.00 177.91 1orl n SER 42 N -3.57 4.52 0.00 6.66 7.64 -1.26 -3.17 113.62 124.45 1orl n SER 42 Ca 0.07 -2.61 0.00 0.00 1.01 0.00 0.00 58.87 57.35 1orl n SER 42 Cb 0.55 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1orl n SER 42 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1orl n ASP 43 N 5.63 0.00 -3.89 6.43 8.00 -1.26 -5.02 116.55 126.44 1orl n ASP 43 Ca 0.54 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.75 1orl n ASP 43 Cb 0.30 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.28 1orl n ASP 43 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1orl s TYR 44 N -1.00 3.46 -0.39 1.24 2.02 -1.19 -4.69 117.35 116.80 1orl s TYR 44 Ca 0.00 -3.30 0.27 0.00 -0.37 0.00 0.00 57.07 53.67 1orl s TYR 44 Cb 0.00 -2.68 0.94 0.00 -0.40 0.00 0.00 41.96 39.82 1orl s TYR 44 CO 0.00 -0.58 1.78 -1.00 -1.57 0.00 0.00 175.55 174.19 1orl h PRO 45 N 5.54 0.00 -0.03 -1.71 0.13 -1.74 -3.39 132.00 130.79 1orl h PRO 45 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1orl h PRO 45 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1orl h PRO 45 CO 0.71 0.00 0.00 1.17 -0.23 0.00 0.00 178.00 179.65